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BDBM50149 MLS000561155::N-[4-methyl-5-[2-(o-anisidino)thiazol-4-yl]thiazol-2-yl]-4-nitro-benzamide::N-[5-[2-(2-methoxyanilino)-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]-4-nitrobenzamide::N-[5-[2-(2-methoxyanilino)-4-thiazolyl]-4-methyl-2-thiazolyl]-4-nitrobenzamide::N-[5-[2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]-4-nitro-benzamide::SMR000156180::cid_11958822

SMILES: COc1ccccc1Nc1nc(cs1)-c1sc(NC(=O)c2ccc(cc2)[N+]([O-])=O)nc1C

InChI Key: InChIKey=IKFYVRANIDGVCD-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50149   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM50149
PNG
(MLS000561155 | N-[4-methyl-5-[2-(o-anisidino)thiaz...)
Show SMILES COc1ccccc1Nc1nc(cs1)-c1sc(NC(=O)c2ccc(cc2)[N+]([O-])=O)nc1C
Show InChI InChI=1S/C21H17N5O4S2/c1-12-18(16-11-31-20(24-16)23-15-5-3-4-6-17(15)30-2)32-21(22-12)25-19(27)13-7-9-14(10-8-13)26(28)29/h3-11H,1-2H3,(H,23,24)(H,22,25,27)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 449n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q23X8539
More data for this
Ligand-Target Pair